4-Iododiphenyl ether

HCID 520399CAS 2974-94-9

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Grundinformationen

Standard-SMILES: Ic1ccc(Oc2ccccc2)cc1
InChIKey: BDKOUDYNKRCDEC-UHFFFAOYSA-N
Summenformel: C12H9IO
Durchschnittliche Molmasse: 296,1 g/mol
Monoisotopische Masse: 295,96981

Namen und Bezeichner

Bevorzugter Name: 4-Iododiphenyl ether
IUPAC: 1-iodo-4-phenoxybenzene
Englischer Name: 4-Iododiphenyl ether
Summenformel: C12H9IO
Molmasse: 296.1

Namen und Synonyme

4-Iododiphenyl etherRefChem:524254675-843-61-Iodo-4-phenoxybenzene2974-94-91-Iodo-4-phenoxy-benzeneBenzene, 1-iodo-4-phenoxy-MFCD000606664-Phenoxyphenyl iodide4-iodophenyl phenyl ether4-phenoxyiodobenzene4,4'-iododiphenyl ether

Weitere Namen anzeigen

4-iodiphenyl etherp-PhenoxyiodobenzenePhenyl iodophenyl ether4-Iodophenyl phenyletherBenzene,1-iodo-4-phenoxy-1-iodo-4-(2-phenoxyphenyl)benzene

SCHEMBL46981-Iodo-4-phenoxybenzene #SCHEMBL45734824-iododiphenyl ether, AldrichCPRDTXSID00334337AKOS015964702AB91861FS-3945

Datenbank-Bezeichner

CAS: 2974-94-9
PubChem CID: 520399
DTXSID: DTXSID00334337
EC Number: 675-843-6
Nikkaji: J323.620J

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 4,9
Polarare Oberfläche (TPSA): 9,2 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 2
Schwere Atome: 14
Formalladung: 0
Komplexität: 158

Physikochemische Eigenschaften

Schmelzpunkt: 43 · 43~45℃
Siedepunkt: 105 · 105-115 °C(Press: 0.01 Torr)
Dichte: 1.626 · 1.626±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C(protect from light)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (33.3%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (66.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.